1D-myo-inositol 1,4-bisphosphate (CHEBI:17816)

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ChEBI Name	*1D-myo-inositol 1,4-bisphosphate*

ChEBI ID	CHEBI:17816

ChEBI ASCII Name	1D-myo-inositol 1,4-bisphosphate

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:19193, CHEBI:39760, CHEBI:11353, CHEBI:812, CHEBI:12827

Supplier Information

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Formula

C6H14O12P2

Net Charge

Average Mass

340.11568

Monoisotopic Mass

339.99605

InChI

InChI=1S/C6H14O12P2/c7-1-2(8)6(18-20(14,15)16)4(10)3(9)5(1)17-19(11,12)13/h1-10H,(H2,11,12,13)(H2,14,15,16)/t1-,2-,3-,4+,5+,6+/m1/s1

InChIKey

PELZSPZCXGTUMR-RTPHHQFDSA-N

SMILES

O[C@H]1[C@@H](O)[C@@H](OP(O)(O)=O)[C@H](O)[C@@H](O)[C@@H]1OP(O)(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed

Roles Classification
Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

ChEBI Ontology
Outgoing	1D-myo-inositol 1,4-bisphosphate (CHEBI:17816) has functional parent myo-inositol (CHEBI:17268) 1D-myo-inositol 1,4-bisphosphate (CHEBI:17816) has role mouse metabolite (CHEBI:75771) 1D-myo-inositol 1,4-bisphosphate (CHEBI:17816) is a myo-inositol bisphosphate (CHEBI:25443) 1D-myo-inositol 1,4-bisphosphate (CHEBI:17816) is conjugate acid of 1D-myo-inositol 1,4-bisphosphate(4−) (CHEBI:58282)

Incoming	1D-myo-inositol 1,4-bisphosphate(4−) (CHEBI:58282) is conjugate base of 1D-myo-inositol 1,4-bisphosphate (CHEBI:17816)

IUPAC Name

1D-myo-inositol 1,4-bis(dihydrogen phosphate)

Last Modified

27 January 2016